3-Chloro-2-piperidin-1-yl-phenylamine

Base Information

• Chemical Name: 3-Chloro-2-piperidin-1-yl-phenylamine
• CAS No.: 58785-06-1
• Molecular Formula: C11H15ClN2
• Molecular Weight: 210.706
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID40359221
• Wikidata: Q82140322
• Mol file: 58785-06-1.mol

Synonyms:58785-06-1;3-Chloro-2-piperidin-1-yl-phenylamine;3-chloro-2-(piperidin-1-yl)aniline;3-Chloro-2-(1-piperidinyl)aniline;(3-CHLORO-2-PIPERIDIN-1-YLPHENYL)AMINE;3-chloro-2-piperidin-1-ylaniline;3-chloro-2-piperidin-1-ylaniline dihydrochloride;MFCD04971011;3-chloro-2-piperidinoaniline;SCHEMBL5092052;DTXSID40359221;AC6412;STK147877;3-Chloro-2-piperidin-1-ylphenylamine;AKOS000103633;SY038381;BB 0245139;CS-0312829;A914238

Chemical Property of 3-Chloro-2-piperidin-1-yl-phenylamine

Chemical Property:

• Vapor Pressure: 6.3E-05mmHg at 25°C
• Boiling Point: 345.1°C at 760 mmHg
• Flash Point: 162.5°C
• PSA: 29.26000
• Density: 1.197g/cm³
• LogP: 3.55870
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 210.0923762
• Heavy Atom Count: 14
• Complexity: 180

Purity/Quality:

97% ^*data from raw suppliers

3-Chloro-2-piperidin-1-yl-phenylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C2=C(C=CC=C2Cl)N

Technology Process of 3-Chloro-2-piperidin-1-yl-phenylamine

There total 3 articles about 3-Chloro-2-piperidin-1-yl-phenylamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 79.5%

1-(2-chloro-6-nitrophenyl)piperidine (3970-42-1) → 3-chloro-2-(piperidin-1-yl)aniline (58785-06-1)

Guidance literature:

With hydrogenchloride; iron; ammonium chloride; In water; isopropyl alcohol; for 1h; Reflux;

Reference yield:

1-(2-chloro-6-nitrophenyl)piperidine (3970-42-1) + 4-methoxy-2-piperidin-1-yl-phenylamine (854044-32-9) → 3-chloro-2-(piperidin-1-yl)aniline (58785-06-1)

Guidance literature:

Pd-C;

Reference yield:

1-chloro-2-fluoro-3-nitrobenzene (2106-49-2) → 3-chloro-2-(piperidin-1-yl)aniline (58785-06-1)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate; piperidine / N,N-dimethyl-formamide / 12 h / 60 °C

2: ammonium chloride; iron; hydrogenchloride / water; isopropyl alcohol / 1 h / Reflux

With piperidine; hydrogenchloride; iron; potassium carbonate; ammonium chloride; In water; N,N-dimethyl-formamide; isopropyl alcohol;

upstream raw materials:

1-(2-chloro-6-nitrophenyl)piperidine

4-methoxy-2-piperidin-1-yl-phenylamine

1-chloro-2-fluoro-3-nitrobenzene

Downstream raw materials:

5-cyano-furan-2-carboxylic acid (3-chloro-2-piperidin-1-yl-phenyl)-amide

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